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PubMed code 7996549

Compile data set for download or QSAR
Found 40 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Delta-type opioid receptor


(MOUSE)		BDBM50038405
PNG
((4R,7S,10R)-7-Benzyl-10-{[(2S,3R)-3-(4-hydroxy-phe...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H]2NCC[C@@H]2c2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20+,21+,22+,23-/m1/s1
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 0.660n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50000655
PNG
((4R,7S,10R)-10-[(S)-2-Amino-3-(4-hydroxy-phenyl)-p...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C26H32N4O6S2/c1-26(2)21(25(35)36)30-23(33)19(13-15-6-4-3-5-7-15)28-24(34)20(14-37-38-26)29-22(32)18(27)12-16-8-10-17(31)11-9-16/h3-11,18-21,31H,12-14,27H2,1-2H3,(H,28,34)(H,29,32)(H,30,33)(H,35,36)/t18-,19-,20-,21+/m0/s1
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 0.740n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038403
PNG
((4R,7S,10R)-7-Benzyl-10-[(R)-3-(4-hydroxy-phenyl)-...)
Show SMILES CN[C@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C27H34N4O6S2/c1-27(2)22(26(36)37)31-24(34)20(14-16-7-5-4-6-8-16)29-25(35)21(15-38-39-27)30-23(33)19(28-3)13-17-9-11-18(32)12-10-17/h4-12,19-22,28,32H,13-15H2,1-3H3,(H,29,35)(H,30,33)(H,31,34)(H,36,37)/t19-,20+,21+,22-/m1/s1
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 2.40n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038402
PNG
((4R,7S,10R)-7-Benzyl-10-{[(2S,3S)-3-(4-hydroxy-phe...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H]2NCC[C@H]2c2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20-,21-,22-,23+/m0/s1
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 2.40n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038406
PNG
((4R,7S,10R)-10-[((R)-2-Amino-5-hydroxy-indane-2-ca...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@]2(N)Cc3ccc(O)cc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C27H32N4O6S2/c1-26(2)21(24(35)36)31-22(33)19(10-15-6-4-3-5-7-15)29-23(34)20(14-38-39-26)30-25(37)27(28)12-16-8-9-18(32)11-17(16)13-27/h3-9,11,19-21,32H,10,12-14,28H2,1-2H3,(H,29,34)(H,30,37)(H,31,33)(H,35,36)/t19-,20-,21+,27+/m0/s1
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 13n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038404
PNG
((4R,7S,10R)-10-[((S)-2-Amino-6-hydroxy-1,2,3,4-tet...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@]2(N)CCc3cc(O)ccc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-27(2)22(25(36)37)32-23(34)20(12-16-6-4-3-5-7-16)30-24(35)21(15-39-40-27)31-26(38)28(29)11-10-17-13-19(33)9-8-18(17)14-28/h3-9,13,20-22,33H,10-12,14-15,29H2,1-2H3,(H,30,35)(H,31,38)(H,32,34)(H,36,37)/t20-,21-,22+,28-/m0/s1
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 20n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50453515
PNG
(CHEMBL2111933)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@]2(N)CCc3cc(O)ccc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-27(2)22(25(36)37)32-23(34)20(12-16-6-4-3-5-7-16)30-24(35)21(15-39-40-27)31-26(38)28(29)11-10-17-13-19(33)9-8-18(17)14-28/h3-9,13,20-22,33H,10-12,14-15,29H2,1-2H3,(H,30,35)(H,31,38)(H,32,34)(H,36,37)/t20-,21-,22+,28+/m0/s1
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 24n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50000655
PNG
((4R,7S,10R)-10-[(S)-2-Amino-3-(4-hydroxy-phenyl)-p...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C26H32N4O6S2/c1-26(2)21(25(35)36)30-23(33)19(13-15-6-4-3-5-7-15)28-24(34)20(14-37-38-26)29-22(32)18(27)12-16-8-10-17(31)11-9-16/h3-11,18-21,31H,12-14,27H2,1-2H3,(H,28,34)(H,29,32)(H,30,33)(H,35,36)/t18-,19-,20-,21+/m0/s1
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 52n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50453517
PNG
(CHEMBL2111934)
Show SMILES [H][C@]1(NCC[C@@H]1c1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20+,21+,22-,23-/m1/s1
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 84n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038405
PNG
((4R,7S,10R)-7-Benzyl-10-{[(2S,3R)-3-(4-hydroxy-phe...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H]2NCC[C@@H]2c2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20+,21+,22+,23-/m1/s1
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 110n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038403
PNG
((4R,7S,10R)-7-Benzyl-10-[(R)-3-(4-hydroxy-phenyl)-...)
Show SMILES CN[C@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C27H34N4O6S2/c1-27(2)22(26(36)37)31-24(34)20(14-16-7-5-4-6-8-16)29-25(35)21(15-38-39-27)30-23(33)19(28-3)13-17-9-11-18(32)12-10-17/h4-12,19-22,28,32H,13-15H2,1-3H3,(H,29,35)(H,30,33)(H,31,34)(H,36,37)/t19-,20+,21+,22-/m1/s1
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 180n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038404
PNG
((4R,7S,10R)-10-[((S)-2-Amino-6-hydroxy-1,2,3,4-tet...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@]2(N)CCc3cc(O)ccc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-27(2)22(25(36)37)32-23(34)20(12-16-6-4-3-5-7-16)30-24(35)21(15-39-40-27)31-26(38)28(29)11-10-17-13-19(33)9-8-18(17)14-28/h3-9,13,20-22,33H,10-12,14-15,29H2,1-2H3,(H,30,35)(H,31,38)(H,32,34)(H,36,37)/t20-,21-,22+,28-/m0/s1
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 230n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50453515
PNG
(CHEMBL2111933)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@]2(N)CCc3cc(O)ccc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-27(2)22(25(36)37)32-23(34)20(12-16-6-4-3-5-7-16)30-24(35)21(15-39-40-27)31-26(38)28(29)11-10-17-13-19(33)9-8-18(17)14-28/h3-9,13,20-22,33H,10-12,14-15,29H2,1-2H3,(H,30,35)(H,31,38)(H,32,34)(H,36,37)/t20-,21-,22+,28+/m0/s1
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 310n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50453516
PNG
(CHEMBL2111935)
Show SMILES [H][C@]1(NCC[C@H]1c1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20-,21-,22+,23+/m0/s1
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 340n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038402
PNG
((4R,7S,10R)-7-Benzyl-10-{[(2S,3S)-3-(4-hydroxy-phe...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H]2NCC[C@H]2c2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20-,21-,22-,23+/m0/s1
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 720n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038406
PNG
((4R,7S,10R)-10-[((R)-2-Amino-5-hydroxy-indane-2-ca...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@]2(N)Cc3ccc(O)cc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C27H32N4O6S2/c1-26(2)21(24(35)36)31-22(33)19(10-15-6-4-3-5-7-15)29-23(34)20(14-38-39-26)30-25(37)27(28)12-16-8-9-18(32)11-17(16)13-27/h3-9,11,19-21,32H,10,12-14,28H2,1-2H3,(H,29,34)(H,30,37)(H,31,33)(H,35,36)/t19-,20-,21+,27+/m0/s1
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 840n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038408
PNG
((4R,7S,10R)-10-[(R)-2-Amino-3-(4-hydroxy-phenyl)-p...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H](N)Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C26H32N4O6S2/c1-26(2)21(25(35)36)30-23(33)19(13-15-6-4-3-5-7-15)28-24(34)20(14-37-38-26)29-22(32)18(27)12-16-8-10-17(31)11-9-16/h3-11,18-21,31H,12-14,27H2,1-2H3,(H,28,34)(H,29,32)(H,30,33)(H,35,36)/t18-,19+,20+,21-/m1/s1
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 1.20E+3n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50453518
PNG
(CHEMBL2111936)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@]2(N)Cc3ccc(O)cc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C27H32N4O6S2/c1-26(2)21(24(35)36)31-22(33)19(10-15-6-4-3-5-7-15)29-23(34)20(14-38-39-26)30-25(37)27(28)12-16-8-9-18(32)11-17(16)13-27/h3-9,11,19-21,32H,10,12-14,28H2,1-2H3,(H,29,34)(H,30,37)(H,31,33)(H,35,36)/t19-,20-,21+,27-/m0/s1
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 1.70E+3n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038407
PNG
((4R,7S,10R)-10-[(S)-2-Amino-3-(4-hydroxy-phenyl)-2...)
Show SMILES C[C@](N)(Cc1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C27H34N4O6S2/c1-26(2)21(24(35)36)31-22(33)19(13-16-7-5-4-6-8-16)29-23(34)20(15-38-39-26)30-25(37)27(3,28)14-17-9-11-18(32)12-10-17/h4-12,19-21,32H,13-15,28H2,1-3H3,(H,29,34)(H,30,37)(H,31,33)(H,35,36)/t19-,20-,21+,27-/m0/s1
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 2.10E+3n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038409
PNG
((4R,7S,10R)-7-Benzyl-10-[((S)-7-hydroxy-1,2,3,4-te...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@H]2Cc3ccc(O)cc3CN2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C27H32N4O6S2/c1-27(2)22(26(36)37)31-24(34)20(10-15-6-4-3-5-7-15)29-25(35)21(14-38-39-27)30-23(33)19-12-16-8-9-18(32)11-17(16)13-28-19/h3-9,11,19-22,28,32H,10,12-14H2,1-2H3,(H,29,35)(H,30,33)(H,31,34)(H,36,37)/t19-,20-,21-,22+/m0/s1
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 2.40E+3n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was evaluated for binding affinity against delta opioid receptor of mouse vas deferens using [3H]-DPDPE

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50453516
PNG
(CHEMBL2111935)
Show SMILES [H][C@]1(NCC[C@H]1c1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20-,21-,22+,23+/m0/s1
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 4.44E+3n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038407
PNG
((4R,7S,10R)-10-[(S)-2-Amino-3-(4-hydroxy-phenyl)-2...)
Show SMILES C[C@](N)(Cc1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C27H34N4O6S2/c1-26(2)21(24(35)36)31-22(33)19(13-16-7-5-4-6-8-16)29-23(34)20(15-38-39-26)30-25(37)27(3,28)14-17-9-11-18(32)12-10-17/h4-12,19-21,32H,13-15,28H2,1-3H3,(H,29,34)(H,30,37)(H,31,33)(H,35,36)/t19-,20-,21+,27-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50453518
PNG
(CHEMBL2111936)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@]2(N)Cc3ccc(O)cc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C27H32N4O6S2/c1-26(2)21(24(35)36)31-22(33)19(10-15-6-4-3-5-7-15)29-23(34)20(14-38-39-26)30-25(37)27(28)12-16-8-9-18(32)11-17(16)13-27/h3-9,11,19-21,32H,10,12-14,28H2,1-2H3,(H,29,34)(H,30,37)(H,31,33)(H,35,36)/t19-,20-,21+,27-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038409
PNG
((4R,7S,10R)-7-Benzyl-10-[((S)-7-hydroxy-1,2,3,4-te...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@H]2Cc3ccc(O)cc3CN2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C27H32N4O6S2/c1-27(2)22(26(36)37)31-24(34)20(10-15-6-4-3-5-7-15)29-25(35)21(14-38-39-27)30-23(33)19-12-16-8-9-18(32)11-17(16)13-28-19/h3-9,11,19-22,28,32H,10,12-14H2,1-2H3,(H,29,35)(H,30,33)(H,31,34)(H,36,37)/t19-,20-,21-,22+/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038408
PNG
((4R,7S,10R)-10-[(R)-2-Amino-3-(4-hydroxy-phenyl)-p...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H](N)Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C26H32N4O6S2/c1-26(2)21(25(35)36)30-23(33)19(13-15-6-4-3-5-7-15)28-24(34)20(14-37-38-26)29-22(32)18(27)12-16-8-10-17(31)11-9-16/h3-11,18-21,31H,12-14,27H2,1-2H3,(H,28,34)(H,29,32)(H,30,33)(H,35,36)/t18-,19+,20+,21-/m1/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50453517
PNG
(CHEMBL2111934)
Show SMILES [H][C@]1(NCC[C@@H]1c1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20+,21+,22-,23-/m1/s1
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 1.00E+4n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor of guinea pig brain membrane

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038405
PNG
((4R,7S,10R)-7-Benzyl-10-{[(2S,3R)-3-(4-hydroxy-phe...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H]2NCC[C@@H]2c2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20+,21+,22+,23-/m1/s1
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n/an/a 1.60n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against delta opioid receptor in mouse vas deferens assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50000655
PNG
((4R,7S,10R)-10-[(S)-2-Amino-3-(4-hydroxy-phenyl)-p...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C26H32N4O6S2/c1-26(2)21(25(35)36)30-23(33)19(13-15-6-4-3-5-7-15)28-24(34)20(14-37-38-26)29-22(32)18(27)12-16-8-10-17(31)11-9-16/h3-11,18-21,31H,12-14,27H2,1-2H3,(H,28,34)(H,29,32)(H,30,33)(H,35,36)/t18-,19-,20-,21+/m0/s1
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n/an/a 4.20n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against delta opioid receptor in mouse vas deferens assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038403
PNG
((4R,7S,10R)-7-Benzyl-10-[(R)-3-(4-hydroxy-phenyl)-...)
Show SMILES CN[C@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C27H34N4O6S2/c1-27(2)22(26(36)37)31-24(34)20(14-16-7-5-4-6-8-16)29-25(35)21(15-38-39-27)30-23(33)19(28-3)13-17-9-11-18(32)12-10-17/h4-12,19-22,28,32H,13-15H2,1-3H3,(H,29,35)(H,30,33)(H,31,34)(H,36,37)/t19-,20+,21+,22-/m1/s1
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n/an/a 5.70n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against delta opioid receptor in mouse vas deferens assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038402
PNG
((4R,7S,10R)-7-Benzyl-10-{[(2S,3S)-3-(4-hydroxy-phe...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H]2NCC[C@H]2c2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20-,21-,22-,23+/m0/s1
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n/an/a 75n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against delta opioid receptor in mouse vas deferens assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038404
PNG
((4R,7S,10R)-10-[((S)-2-Amino-6-hydroxy-1,2,3,4-tet...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@]2(N)CCc3cc(O)ccc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-27(2)22(25(36)37)32-23(34)20(12-16-6-4-3-5-7-16)30-24(35)21(15-39-40-27)31-26(38)28(29)11-10-17-13-19(33)9-8-18(17)14-28/h3-9,13,20-22,33H,10-12,14-15,29H2,1-2H3,(H,30,35)(H,31,38)(H,32,34)(H,36,37)/t20-,21-,22+,28-/m0/s1
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n/an/a 110n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against delta opioid receptor in mouse vas deferens assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50453515
PNG
(CHEMBL2111933)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@]2(N)CCc3cc(O)ccc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-27(2)22(25(36)37)32-23(34)20(12-16-6-4-3-5-7-16)30-24(35)21(15-39-40-27)31-26(38)28(29)11-10-17-13-19(33)9-8-18(17)14-28/h3-9,13,20-22,33H,10-12,14-15,29H2,1-2H3,(H,30,35)(H,31,38)(H,32,34)(H,36,37)/t20-,21-,22+,28+/m0/s1
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n/an/a 340n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against delta opioid receptor in mouse vas deferens assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50038406
PNG
((4R,7S,10R)-10-[((R)-2-Amino-5-hydroxy-indane-2-ca...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@]2(N)Cc3ccc(O)cc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C27H32N4O6S2/c1-26(2)21(24(35)36)31-22(33)19(10-15-6-4-3-5-7-15)29-23(34)20(14-38-39-26)30-25(37)27(28)12-16-8-9-18(32)11-17(16)13-27/h3-9,11,19-21,32H,10,12-14,28H2,1-2H3,(H,29,34)(H,30,37)(H,31,33)(H,35,36)/t19-,20-,21+,27+/m0/s1
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n/an/a 340n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against delta opioid receptor in mouse vas deferens assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50000655
PNG
((4R,7S,10R)-10-[(S)-2-Amino-3-(4-hydroxy-phenyl)-p...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C26H32N4O6S2/c1-26(2)21(25(35)36)30-23(33)19(13-15-6-4-3-5-7-15)28-24(34)20(14-37-38-26)29-22(32)18(27)12-16-8-10-17(31)11-9-16/h3-11,18-21,31H,12-14,27H2,1-2H3,(H,28,34)(H,29,32)(H,30,33)(H,35,36)/t18-,19-,20-,21+/m0/s1
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n/an/a 460n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against mu opioid receptor in guinea pig ileum assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038403
PNG
((4R,7S,10R)-7-Benzyl-10-[(R)-3-(4-hydroxy-phenyl)-...)
Show SMILES CN[C@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CSSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)=O
Show InChI InChI=1S/C27H34N4O6S2/c1-27(2)22(26(36)37)31-24(34)20(14-16-7-5-4-6-8-16)29-25(35)21(15-38-39-27)30-23(33)19(28-3)13-17-9-11-18(32)12-10-17/h4-12,19-22,28,32H,13-15H2,1-3H3,(H,29,35)(H,30,33)(H,31,34)(H,36,37)/t19-,20+,21+,22-/m1/s1
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n/an/a 480n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against mu opioid receptor in guinea pig ileum assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038405
PNG
((4R,7S,10R)-7-Benzyl-10-{[(2S,3R)-3-(4-hydroxy-phe...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H]2NCC[C@@H]2c2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20+,21+,22+,23-/m1/s1
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n/an/a 770n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against mu opioid receptor in guinea pig ileum assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038404
PNG
((4R,7S,10R)-10-[((S)-2-Amino-6-hydroxy-1,2,3,4-tet...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@]2(N)CCc3cc(O)ccc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-27(2)22(25(36)37)32-23(34)20(12-16-6-4-3-5-7-16)30-24(35)21(15-39-40-27)31-26(38)28(29)11-10-17-13-19(33)9-8-18(17)14-28/h3-9,13,20-22,33H,10-12,14-15,29H2,1-2H3,(H,30,35)(H,31,38)(H,32,34)(H,36,37)/t20-,21-,22+,28-/m0/s1
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n/an/a 1.80E+3n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against mu opioid receptor in guinea pig ileum assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50453515
PNG
(CHEMBL2111933)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@]2(N)CCc3cc(O)ccc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-27(2)22(25(36)37)32-23(34)20(12-16-6-4-3-5-7-16)30-24(35)21(15-39-40-27)31-26(38)28(29)11-10-17-13-19(33)9-8-18(17)14-28/h3-9,13,20-22,33H,10-12,14-15,29H2,1-2H3,(H,30,35)(H,31,38)(H,32,34)(H,36,37)/t20-,21-,22+,28+/m0/s1
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n/an/a 4.30E+3n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against mu opioid receptor in guinea pig ileum assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038406
PNG
((4R,7S,10R)-10-[((R)-2-Amino-5-hydroxy-indane-2-ca...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@@]2(N)Cc3ccc(O)cc3C2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C27H32N4O6S2/c1-26(2)21(24(35)36)31-22(33)19(10-15-6-4-3-5-7-15)29-23(34)20(14-38-39-26)30-25(37)27(28)12-16-8-9-18(32)11-17(16)13-27/h3-9,11,19-21,32H,10,12-14,28H2,1-2H3,(H,29,34)(H,30,37)(H,31,33)(H,35,36)/t19-,20-,21+,27+/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against mu opioid receptor in guinea pig ileum assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50038402
PNG
((4R,7S,10R)-7-Benzyl-10-{[(2S,3S)-3-(4-hydroxy-phe...)
Show SMILES CC1(C)SSC[C@H](NC(=O)[C@H]2NCC[C@H]2c2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(O)=O
Show InChI InChI=1S/C28H34N4O6S2/c1-28(2)23(27(37)38)32-24(34)20(14-16-6-4-3-5-7-16)30-25(35)21(15-39-40-28)31-26(36)22-19(12-13-29-22)17-8-10-18(33)11-9-17/h3-11,19-23,29,33H,12-15H2,1-2H3,(H,30,35)(H,31,36)(H,32,34)(H,37,38)/t19-,20-,21-,22-,23+/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against mu opioid receptor in guinea pig ileum assay

J Med Chem 37: 4371-83 (1995)


BindingDB Entry DOI: 10.7270/Q2CZ3660
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%